SCHEMBL8908512

SCHEMBL8908512

NNc1ncnc(Nc2ccc(F)c(C(F)(F)F)c2)n1

nearest known ligand 0.51

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
STK17A Q9UEE5 2/20 0.51
STK17B O94768 1/20 0.51
MAPK1 P28482 1/20 0.49
JAK2 O60674 1/20 0.45
CYP3A4 P08684 1/20 0.45
JAK1 P23458 1/20 0.45
JAK3 P52333 1/20 0.45
KDM4E B2RXH2 1/20 0.45
KDR P35968 1/20 0.44
TDO2 P48775 3/20 0.44
HSP90AA1 P07900 1/20 0.43
GRM4 Q14833 2/20 0.43
SMN1; SMN2 Q16637 1/20 0.42
CDC7 O00311 3/20 0.40

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL8908298 0.82 HSP90AA1 (0.53) STK17ASTK17BMAPK1KDM4ETDO2
SCHEMBL3529272 0.75 SLC22A12 (0.49) STK17ASTK17BTDO2GRM4
SCHEMBL12060245 0.75 STK17A (0.46) STK17ASTK17BTDO2HSP90AA1GRM4
SCHEMBL8908486 0.74 STK17A (0.50) STK17ASTK17BKDM4EHSP90AA1
SCHEMBL12060247 0.74 STK17A (0.52) STK17ASTK17BJAK2CYP3A4JAK1
SCHEMBL8908455 0.74 APP (0.54) STK17ASTK17BTDO2GRM4
Hydrochloric Acid SCHEMBL18860171 0.73 SLC22A12 (0.47) STK17ASTK17BTDO2GRM4
SCHEMBL8910305 0.73 NPC1 (0.48) KDM4ESMN1; SMN2
SCHEMBL605710 0.72 SCN9A (0.44) STK17ASTK17BJAK2CYP3A4JAK1
SCHEMBL605711 0.72 SCN9A (0.44) STK17ASTK17BJAK2CYP3A4JAK1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8188273-B2 Insecticidal (1,3,5)-triazinyl phenyl hydrazones DOW AGROSCIENCES, LLC. (US) 2012-05-29 US disclosed
US-8188273-B2 Insecticidal (1,3,5)-triazinyl phenyl hydrazones DOW AGROSCIENCES, LLC. (US) 2012-05-29 US disclosed
US-20120040837-A1 INSECTICIDAL (1,3,5)-TRIAZINYL PHENYL HYDRAZONES DOW AGROSCIENCES LLC (US) 2012-02-16 US disclosed
US-20120040837-A1 INSECTICIDAL (1,3,5)-TRIAZINYL PHENYL HYDRAZONES DOW AGROSCIENCES LLC (US) 2012-02-16 US disclosed
US-8067588-B2 Insecticidal (1,3,5)-triazinyl phenyl hydrazones DOW AGROSCIENCES LLC (US) 2011-11-29 US disclosed
US-8067588-B2 Insecticidal (1,3,5)-triazinyl phenyl hydrazones DOW AGROSCIENCES LLC (US) 2011-11-29 US disclosed
US-20090093481-A1 INSECTICIDAL (1,3,5)-TRIAZINYL PHENYL HYDRAZONES DOW AGROSCIENCES LLC (US) 2009-04-09 US disclosed
US-20090093481-A1 INSECTICIDAL (1,3,5)-TRIAZINYL PHENYL HYDRAZONES DOW AGROSCIENCES LLC (US) 2009-04-09 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090093481-A1 INSECTICIDAL (1,3,5)-TRIAZINYL PHENYL HYDRAZONES HELZ, API5, CRYZ STK17A 2330/4885STK17B 2423/4885MAPK1 3363/4885
US-20120040837-A1 INSECTICIDAL (1,3,5)-TRIAZINYL PHENYL HYDRAZONES HELZ, API5, CRYZ STK17A 2330/4885STK17B 2423/4885MAPK1 3363/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.